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3'-Amino-3'-deoxy-adenosine-5'-thiono-phosphoric acid, bis(4-nitro-phenyl) ester

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3'-Amino-3'-deoxy-adenosine-5'-thiono-phosphoric acid, bis(4-nitro-phenyl) ester
SpectraBase Compound ID 4xngNuCUbHC
InChI InChI=1S/C22H21N8O9PS/c23-17-16(37-22(19(17)31)28-11-27-18-20(24)25-10-26-21(18)28)9-36-40(41,38-14-5-1-12(2-6-14)29(32)33)39-15-7-3-13(4-8-15)30(34)35/h1-8,10-11,16-17,19,22,31H,9,23H2,(H2,24,25,26)
InChIKey ZQJUFKBIHPJNFJ-UHFFFAOYSA-N
Mol Weight 604.49 g/mol
Molecular Formula C22H21N8O9PS
Exact Mass 604.088982 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fn0S4bXUBFe
Name 3'-Amino-3'-deoxy-adenosine-5'-thiono-phosphoric acid, bis(4-nitro-phenyl) ester
CAS Registry Number 67313-19-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H21N8O9PS
InChI InChI=1S/C22H21N8O9PS/c23-17-16(37-22(19(17)31)28-11-27-18-20(24)25-10-26-21(18)28)9-36-40(41,38-14-5-1-12(2-6-14)29(32)33)39-15-7-3-13(4-8-15)30(34)35/h1-8,10-11,16-17,19,22,31H,9,23H2,(H2,24,25,26)
InChIKey ZQJUFKBIHPJNFJ-UHFFFAOYSA-N
Literature Reference M. Morr, L. Ernst, Chem. Ber. 111, 2152 (1978).
NMR Standard CD3OD
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD3OD